Mol:EEL0164
Copyright: ARM project http://www.metabolome.jp/
116117 0 0 0 0 0 0 0 0999 V2000
-13.2973 2.8616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3880 3.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6738 2.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9596 3.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2450 2.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5306 3.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8163 2.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1019 3.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3873 2.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6729 3.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9587 2.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2442 3.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5299 2.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8155 3.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1009 2.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4255 0.6490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7911 1.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0769 0.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3625 1.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6480 0.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9337 1.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1555 0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4411 0.9551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7267 0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0122 0.9551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6738 2.1037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8163 2.1037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9587 2.1037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1009 2.1037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0769 -0.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1555 -0.2996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -0.2996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3867 3.3584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5833 0.9552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1814 2.5258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5705 1.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9115 0.7429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9949 2.7057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7717 0.9711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1374 0.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4231 0.9415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7088 0.5290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9941 0.9412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2798 0.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5654 0.9410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8511 0.5285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1365 0.9407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4224 0.5282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 0.9404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9936 0.5280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2791 0.9402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5647 0.5277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1499 0.9399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1606 3.2798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5264 2.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8119 3.2623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0976 2.8497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3830 3.2620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6689 2.8495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9044 3.3436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1901 2.9311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4755 3.3434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2391 2.9308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9534 3.3431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4230 1.7840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5652 1.7834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7079 1.7829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1501 1.7824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8117 4.1045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9042 4.1859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9536 4.1854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8642 0.5274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6677 2.9305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1330 -0.1706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1330 0.6539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9202 1.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6382 2.8806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1217 2.8800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 3.2937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4260 1.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6504 0.6419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4071 3.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8230 4.1186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7659 1.1972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1559 2.1938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4974 2.9803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.5792 1.0732 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.2384 0.2109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6967 3.1701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6662 1.8816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2660 1.8534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5884 3.1663 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 13.5884 3.9913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4134 3.1663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5884 2.3413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6651 3.1713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2384 3.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9266 -2.9662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9053 -3.2167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.6376 -1.4959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.9266 -3.7734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9053 -2.2652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6376 -2.2652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6215 -2.9662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7702 -1.7616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6410 -4.1859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6215 -3.7911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.9266 -2.2782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.7700 -0.9367 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6245 -3.2123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7996 -3.2123 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.7996 -2.3874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7996 -4.0373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9746 -3.2123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8123 -3.2067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 3 2 1 0 4 3 1 0 5 4 1 0 6 5 1 0 7 6 1 0 8 7 1 0 9 8 1 0 10 9 1 0 11 10 1 0 12 11 1 0 13 12 1 0 14 13 1 0 15 14 1 0 17 16 1 0 18 17 1 0 19 18 1 0 20 19 1 0 21 20 1 0 23 22 1 0 24 23 1 0 25 24 1 0 26 25 1 0 3 27 1 0 7 28 1 0 11 29 1 0 15 30 1 0 18 31 1 0 22 32 1 0 26 33 1 0 15 34 1 0 26 35 1 0 36 37 1 0 37 38 1 0 36 39 1 0 40 38 1 0 41 40 1 0 42 41 1 0 43 42 1 0 44 43 1 0 45 44 1 0 46 45 1 0 47 46 1 0 48 47 1 0 49 48 1 0 50 49 1 0 51 50 1 0 52 51 1 0 53 52 1 0 54 53 1 0 56 55 1 0 57 56 1 0 58 57 1 0 59 58 1 0 60 59 1 0 62 61 1 0 63 62 1 0 64 63 1 0 65 64 1 0 39 55 1 0 42 66 1 0 46 67 1 0 50 68 1 0 54 69 1 0 57 70 1 0 61 71 1 0 65 72 1 0 54 73 1 0 65 74 1 0 34 74 1 0 35 73 1 0 75 76 1 0 21 76 1 0 22 77 1 0 79 80 1 0 61 78 1 0 60 80 1 0 76 81 1 0 77 82 1 0 82 81 1 0 79 83 1 0 83 78 1 0 80 84 1 0 85 86 1 0 86 87 1 0 85 88 1 0 16 88 1 0 1 87 1 0 85 89 1 0 36 90 1 0 36 91 1 0 85 92 1 0 93 94 2 0 93 95 1 0 93 96 1 0 93 97 1 0 90 97 1 0 95 98 1 0
105 99 1 1 104 99 1 1 103105 1 1 103100 1 0 104101 1 0
99102 1 0
106103 1 0 104106 1 0 102107 1 0 105108 1 0
99109 1 0
106110 1 0 111112 1 0 112113 2 0 112114 2 0 112115 1 0 116111 1 0 100116 1 0 101 89 1 0 A 98 Ino A 116 Glc S SKP 6 AUTODRAW FALSE ID EEL0164 FORMULA C94H187O18PS EXACTMASS 1667.31757638 AVERAGEMASS 1668.519541 SMILES C(C1)(CCCC(C)CCCC(C)CCC(CCCC(CCCC(CCCC(C)CCOC(COC(C2O)C(C(O)C2OCOS(O)(=O)=O)(O)CO)(COCCC(C)CCCC(CCCC(C)CCCC(C)CCC(C)CCCC(CCCC(CCCC(C)CCOC(COCCC(C)CC1)([H])COP(OC)(O)=O)C)C)C)[H])C)C)C)C M END
